4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide

C10H17N3O2S2 — CID 61300929

IUPAC4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide
SMILESCN1CCC(NS(=O)(=O)c2cc(N)cs2)CC1
InChIInChI=1S/C10H17N3O2S2/c1-13-4-2-9(3-5-13)12-17(14,15)10-6-8(11)7-16-10/h6-7,9,12H,2-5,11H2,1H3
InChIKeyISDIWYUFLVGYII-UHFFFAOYSA-N
MW275.40 g/mol
LogP0.70
Rot. Bonds3

About 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide

4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide (PubChem CID 61300929) has the molecular formula C10H17N3O2S2 and a molecular weight of 275.40 g/mol. Its IUPAC name is 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide
PubChem CID61300929
Molecular FormulaC10H17N3O2S2
Molecular Weight275.40 g/mol
Exact Mass275.08
IUPAC Name4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide
SMILESCN1CCC(NS(=O)(=O)c2cc(N)cs2)CC1
InChIInChI=1S/C10H17N3O2S2/c1-13-4-2-9(3-5-13)12-17(14,15)10-6-8(11)7-16-10/h6-7,9,12H,2-5,11H2,1H3
InChIKeyISDIWYUFLVGYII-UHFFFAOYSA-N
XLogP0.70
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide (CID 61300929) is 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide is CN1CCC(NS(=O)(=O)c2cc(N)cs2)CC1.
What is the InChIKey of 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide?
The InChIKey is ISDIWYUFLVGYII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S2/c1-13-4-2-9(3-5-13)12-17(14,15)10-6-8(11)7-16-10/h6-7,9,12H,2-5,11H2,1H3.
What are the key properties of 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide?
4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide has a molecular weight of 275.40 g/mol, XLogP of 0.70, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-methylpiperidin-4-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 61300929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).